dimethylsilylidenezirconium(2+); 2-methyl-1-[2-(2-methylpropyl)-1H-inden-1-id-4-yl]naphthalene; dichloride

Systemtic Name: dimethylsilylidenezirconium(2+); 2-methyl-1-[2-(2-methylpropyl)-1H-inden-1-id-4-yl]naphthalene; dichloride Openeye Name: dimethylsilylidenezirconium(2+); 1-(2-isobutyl-1H-inden-1-id-4-yl)-2-methyl-naphthalene; dichloride CAS Name: dimethylsilylidenezirconium(2+); 2-methyl-1-[2-(2-methylpropyl)-1H-inden-1-id-4-yl]naphthalene; dichloride IUPAC Name: dimethylsilylidenezirconium(2+); 2-methyl-1-[2-(2-methylpropyl)-1H-inden-1-id-4-yl]naphthalene; dichloride Traditional Name: dimethylsilylidenezirconium(2+); 1-(2-isobutyl-1H-inden-1-id-4-yl)-2-methyl-naphthalene; dichloride Formula: C100H104Cl2Si2Zr2-2 MolecularWeight: 1615.42076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C=C1)C3=CC=CC4=C3C=C([CH-]4)CC(C)C.CC1=C(C2=CC=CC=C2C=C1)C3=CC=CC4=C3C=C([CH-]4)CC(C)C.CC1=C(C2=CC=CC=C2C=C1)C3=CC=CC4=C3C=C([CH-]4)CC(C)C.CC1=C(C2=CC=CC=C2C=C1)C3=CC=CC4=C3C=C([CH-]4)CC(C)C.C[Si](=[Zr+2])C.C[Si](=[Zr+2])C.[Cl-].[Cl-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2C=C1)C3=CC=CC4=C3C=C([CH-]4)CC(C)C.CC1=C(C2=CC=CC=C2C=C1)C3=CC=CC4=C3C=C([CH-]4)CC(C)C.CC1=C(C2=CC=CC=C2C=C1)C3=CC=CC4=C3C=C([CH-]4)CC(C)C.CC1=C(C2=CC=CC=C2C=C1)C3=CC=CC4=C3C=C([CH-]4)CC(C)C.C[Si](=[Zr+2])C.C[Si](=[Zr+2])C.[Cl-].[Cl-]

InChI

InChI=1S/4C24H23.2C2H6Si.2ClH.2Zr/c4*1-16(2)13-18-14-20-8-6-10-22(23(20)15-18)24-17(3)11-12-19-7-4-5-9-21(19)24;2*1-3-2;;;;/h4*4-12,14-16H,13H2,1-3H3;2*1-2H3;2*1H;;/q4*-1;;;;;2*+2/p-2